CID 4690295

54255-56-0

Structural Information

Molecular Formula

C₁₃H₉Cl₂NO₂

SMILES

C1=CC=C(C(=C1)NC(=O)C2=C(C=C(C=C2)Cl)Cl)O

InChI

InChI=1S/C13H9Cl2NO2/c14-8-5-6-9(10(15)7-8)13(18)16-11-3-1-2-4-12(11)17/h1-7,17H,(H,16,18)

InChIKey

HGNVTWLOUXXFJN-UHFFFAOYSA-N

Compound name

2,4-dichloro-N-(2-hydroxyphenyl)benzamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 2
References: 0
Patents: 281.00104 Da
Monoisotopic Mass: 4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	282.00832	157.1
[M+Na]+	303.99026	166.8
[M-H]-	279.99376	162.4
[M+NH4]+	299.03486	173.7
[M+K]+	319.96420	160.2
[M+H-H2O]+	263.99830	152.0
[M+HCOO]-	325.99924	171.4
[M+CH3COO]-	340.01489	196.6
[M+Na-2H]-	301.97571	161.0
[M]+	281.00049	159.6
[M]-	281.00159	159.6

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.